Veratramine; 20-Epimer, 23-O-β-D-glucopyranoside
AlkaPlorer ID: AK317479
Synonym: 23-O-β-D-Glucopyranosyl-20-isoveratramine
IUPAC Name: 2-[2-[1-(3-hydroxy-10,11b-dimethyl-1,2,3,4,6,6a,11,11a-octahydrobenzo[a]fluoren-9-yl)ethyl]-5-methylpiperidin-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
Structure
SMILES: CC1=C2CC3C(CC=C4CC(O)CCC43C)C2=CC=C1C(C)C1NCC(C)CC1OC1OC(CO)C(O)C(O)C1O
InChI: InChI=1S/C33H49NO7/c1-16-11-26(40-32-31(39)30(38)29(37)27(15-35)41-32)28(34-14-16)18(3)21-7-8-22-23-6-5-19-12-20(36)9-10-33(19,4)25(23)13-24(22)17(21)2/h5,7-8,16,18,20,23,25-32,34-39H,6,9-15H2,1-4H3
InChIKey: AYOMVZRFSHNOFY-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Veratrum patulum | Veratrum | Melanthiaceae | Liliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 571.7550000000003
TPSA？: 131.64
MolLogP？: 2.41872
Number of H-Donors: 6
Number of H-Acceptors: 8
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|